V027-5122 Screening compound: 3-{2-[(2,4-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(4-methoxyphenyl)propanamide

V027-5122 Screening compound: 3-{2-[(2,4-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(4-methoxyphenyl)propanamide
V027-5122 Screening compound: 3-{2-[(2,4-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(4-methoxyphenyl)propanamide alternative view

Chemical Structure Depiction of ChemDiv screening compound V027-5122
3-{2-[(2,4-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(4-methoxyphenyl)propanamide

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

V027-5122

Molecular Formula

C24H21Cl2N3O2 (C24 H21 Cl2 N3 O2)

Compound Name

3-{2-[(2,4-dichlorophenyl)methyl]-1H-1,3-benzodiazol-1-yl}-N-(4-methoxyphenyl)propanamide

IUPAC name

3-{2-[(24-dichlorophenyl)methyl]-1H-13-benzodiazol-1-yl}-N-(4-methoxyphenyl)propanamide

SMILES

COc(cc1)ccc1NC(CCn1c(cccc2)c2nc1Cc(ccc(Cl)c1)c1Cl)=O

InChI

InChI=1S/C24H21Cl2N3O2/c1-31-19-10-8-18(9-11-19)27-24(30)12-13-29-22-5-3-2-4-21(22)28-23(29)14-16-6-7-17(25)15-20(16)26/h2-11,15H,12-14H2,1H3,(H,27,30)

InChI Key

DNBCHVMPOZCDBR-UHFFFAOYSA-N

MDL Number (MFCD)

MFCD19791238

Chemical and Physical Properties

Saltdata

not_available

Molecular Weight

454.36

Hydrogen Bond Acceptors Count

4.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

8.00

Number of Nitrogen and Oxygen Atoms

5

Partition Coefficient, logP

6.150

Distribution Coefficient, logD

6.149

Water Solubility, LogSw

-6.08

Polar Surface Area

41.543

Acid Dissociation Constant (pKa)

11.86

Base Dissociation Constant (pKb)

4.82

Number of Chiral Centers

0.00

Percent sp3 carbon bonding

16.70

V027-5122 in Drug Discovery

Included in Screening Libraries

CNS Targets (44014 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Nervous system

References: we are preparing a list of scientific research reports with V027-5122 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound V027-5122?
Check Price and Availability of V027-5122, then you can add required amount to the Shopping Cart. In the Shopping Cart you can again refine your selection. Once you are sure that it’s exactly what you want you can move forward with the Checkout (to pay online by credit card, or via PayPal), or Request a Quote.
What is the minimum amount of V027-5122 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for V027-5122
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for V027-5122
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of V027-5122 available by request